N-(2-tert-butyl-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl)-3,4,5-triethoxybenzamide
Chemical Structure Depiction of
N-(2-tert-butyl-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl)-3,4,5-triethoxybenzamide
N-(2-tert-butyl-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl)-3,4,5-triethoxybenzamide
Compound characteristics
| Compound ID: | K410-0064 |
| Compound Name: | N-(2-tert-butyl-5,5-dioxo-2,4,5,6-tetrahydro-5lambda~6~-thieno[3,4-c]pyrazol-3-yl)-3,4,5-triethoxybenzamide |
| Molecular Weight: | 465.57 |
| Molecular Formula: | C22 H31 N3 O6 S |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)C(Nc1c2CS(Cc2nn1C(C)(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3294 |
| logD: | 2.3294 |
| logSw: | -2.9061 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.385 |
| InChI Key: | JMIMAVJVQAABGZ-UHFFFAOYSA-N |